N-(3,5-ditert-butylphenyl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide

Systemtic Name: N-(3,5-ditert-butylphenyl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Openeye Name: N-(3,5-ditert-butylphenyl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide CAS Name: N-(3,5-ditert-butylphenyl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]propanamide IUPAC Name: N-(3,5-ditert-butylphenyl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]propanamide Traditional Name: N-(3,5-ditert-butylphenyl)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]propionamide Formula: C20H29N3OS2 MolecularWeight: 391.59376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCCC(=O)NC2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C

Isomeric SMILES

CC1=NN=C(S1)SCCC(=O)NC2=CC(=CC(=C2)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C20H29N3OS2/c1-13-22-23-18(26-13)25-9-8-17(24)21-16-11-14(19(2,3)4)10-15(12-16)20(5,6)7/h10-12H,8-9H2,1-7H3,(H,21,24)